Benzene → HCID 68677136, 화합물
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[CH:22]1([NH2:25])[CH2:23][CH2:24]1.[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][cH:10][c:11]1[S:12](=[O:13])(=[O:14])[Cl:15].[K+:16].[K+:17].[O-:18][C:19]([O-:20])=[O:21].[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][cH:10][c:11]1[S:12](=[O:13])(=[O:14])[NH:25][CH:22]1[CH2:23][CH2:24]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-ca1ea9886422450393ac3c1377889b46
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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